2008年7月 至今           汕头大学理学院化学系    教授、硕士生导师

2007年11月-2008年5月   香港大学                高级研究助理

2006年9月 至 2008年7月    牡丹江师范学院化学系    教授、硕士生导师

2005年8月 至 2006年11月   美国加州州立大学        高级访问学者

从事计算机化学研究工作，主要采用机器学习(ML)、材料基因组学(MGI)、分子模拟(MC, MD)、量子化学(QC)以及实验手段，进行：

1、MOFs吸附剂、催化剂高通量筛选与设计与合成；

2、抗肿瘤靶向药物高通量筛选与设计、合成。

[ 1 ] 广东省质量工程项目: 辅助分子模拟手段的《无机化学》课堂教学；

[ 2 ] 横向 理论研究放射性元素配合物结构与稳定性；

[ 3 ] 广东省自然科学基金面上项目: OH自由基与一些VOCs的催化及光化学反应机理；(编号：s2013010014476)；

[ 4 ] 广东省质量工程项目: 辅助分子模拟手段的《波谱分析》课堂教学；

[ 5 ] 黑龙江省自然科学基金面上项目：含Si, C, P, S的元素分子材料结构与稳定性的理论研究；

[1]Heng Liang, Kun Jiang, Tong-An Yan, and Guang-Hui Chen* XGBoost: An Optimal Machine Learning Model with Just Structural  Features to Discover MOF Adsorbents of Xe/Kr ACS Omega (Cover Article) 2021 doi:10.1021/acsomega.1c00100

[2]Wang-qiang Lin, Fang Li, Guang-hui Chen*, Song-tao Xiao, Ling-yu Wang, Qiang Wang, A study on the adsorptions of SO2 on pristine and phosphorus-doped silicon carbide nanotubes as potential gas sensors. Ceramics International, 2020, 46, 25171-25188.

[3]Wang-qiang Lin, Song-tao Xiao, Hui-bo Li, Ying-gen Ouyang, Ling-yu Wang, Qiang Wang, Guang-hui Chen*, Theoretical study of NO2 adsorption on SiCNT and P-doped SiCNT. Physica E: Low-dimensional Systems and Nanostructures, 2020, 114519.

[4]Xue-Lian Xiong, Guang-Hui Chen*, Songtao Xiao, Ying-Gen Ouyang, Hui-Bo Li, and Qiang Wang, New Discovery of Metal−Organic Framework UTSA-280: Ultrahigh Adsorption Selectivity of Krypton Over Xenon The Journal of Physical Chemistry C, 2020, 126, 14603-14612

[5]Jiao-jiao Qian, Guang-hui Chen*, Song-tao Xiao, Hui-bo Li Switching Xe/Kr adsorption selectivity in modified SBMOF-1: a theoretical study RSC Advances, 2020, 10, 17195-17204.

[6]Chong-Wei Ding, Wen-zhi Luo, Jie-Yi Zhou, Xin-Jie Ma, Guang-Hui Chen,  Xiao-Ping Zhou* and Dan Li* Hydroxo Iron(III) Sites in a Metal−Organic Framework: Proton-Coupled Electron Transfer and Catalytic Oxidation of Alcohol with  Molecular Oxygen ACS Applied Materials & Interfaces 2019, 11, 45621−45628

[7]Qiang Wang,* Pengfei Liu, Xin Bian, Jianmei Huang, Wei-qi Li, Guang-hui Chen, Yanhui Yang*, Adlayer-substrate Interactions in Controlled Growth of Graphene/h-BN Heterostructure on Ni(111) and Cu(111) Surfaces, Applied Surface Science, 2019, 480, 154-161.

[8]Wen-zhi Luo, Guang-hui Chen*, Song-tao Xiao*, Qiang Wang, Ze-kun Huang and Ling-yu Wang, The Enzyme-Like Catalytic Hydrogen Abstraction Reaction Mechanisms of Cyclic Hydrocarbons with Magnesium-Diluted Fe-MOF-74, RSC Advances, 2019, 9, 23622-23632.

[9]Yi-Bing Su, Yong-Jun Yuan, Xiao-Le Liu, Guang-Hui Chen,* Xin Chen,* Zhen-Tao Yu,* and Zhi-Gang Zou, A Heterobimetallic AuIII-PtII Photocatalyst for Water Reduction to Hydrogen, Chemistry–An Asian Journal, 2019, 14, 527-531.

[10]Ling-Xia Yang, Wan-Fa Yang, Yong-Jun Yuan, Yi-Bing Su, Miao-Miao Zhou, Xiao-Le Liu, Guang-Hui Chen,* Xin Chen,* Zhen-Tao Yu,* and Zhi-Gang Zou, Visible-Light-Driven Hydrogen Production and Polymerization using Triarylboron-Functionalized Iridium(III) Complexes, Chemistry–An Asian Journal, 2018, 13, 1699-1709.

[11]Shun-Ze Zhan,* Xia Jiang, Ji Zheng, Xin-Da Huang, Guang-Hui Chen and Dan Li,*A Luminescent Supramolecular Cu2I2 (NH3) 2-Sandwiched Cu3 (pyrazolate)3 Adduct as a Temperature Sensor, Dalton Transactions, 2018, 47, 3679-3683.

[12]Qiang Wang,* Xianfei Lu, Yanzhong Zhen, Wei-qi Li, Guang-hui Chen, and Yanhui Yang,* Structure, Stability, Electronic, Magnetic, and Catalytic Properties of Monometallic Pd, Au, and Bimetallic Pd-Au Core-Shell Nanoparticles, The Journal of chemical physics, 2018, 149, 244307.

[13]Ya-Dong Yu, Ling-Bin Meng, Qiu-Cheng Chen, Guang-Hui Chen* and Xiao-Chun Huang,* Substituent Regulated Photoluminescent Thermochromism in A Rare Type of Octahedral Cu4I4 Clusters, New Journal of Chemistry, 2018, 42, 8426-8437.

[14]Fu-hai Li, Dai-rong Hu, Ya-hui Yuan, Bin-bin Luo, Yi-bing Song, Song-tao Xiao, Guang-hui Chen, Yi-wen Fang, and Fu-shen Lu, Zeolite Y Encapsulated Cu (II) and Zn (II)-Imidazole-Salen Catalysts for Benzyl Alcohol Oxidation, Molecular Catalysis, 2018, 452, 75-82.

[15]Wei-Guang Jin, Wei Chen, Pei-Hang Xu, Xin-Wen Lin, Xiao-Chun Huang,* Guang-Hui Chen, Fushen Lu, and Xiao-Ming Chen, An Exceptionally Water Stable Metal–Organic Framework with Amide-Functionalized Cages: Selective CO2/CH4 Uptake, Removal of Antibiotics and Dyes from Water, Chemistry-A European Journal (Hot Paper), 2017, 23, 13058–13066.

[16]Xia Jiang, Guang-hui Chen,* Min-qiang Gu, Qiang Wang, Di Wu,* Theoretical Study and Design of Phosphorescent Cyclometalated (C^C*)PtII(acac) Complexes: The Substituent Effect Controls the Radiative and Nonradiative Decay Processes, The Journal of Physical Chemistry A, 2017, 121, 6231-6242.

[17]Lu Wang, Qiang Wang,* Jianmei Huang, Wei-qi Li, Guang-hui Chen and Yanhui Yang,* Interface and Interaction of Graphene Layers on SiC (0001 [combining macron]) Covered with TiC (111) Intercalation, Physical Chemistry Chemical Physics, 2017, 19, 26765-26775.

[18]Xiao-le Liu, Guang-hui Chen,* Xiu-Jun Wang,* Peng Li, Yi-bing Song and Rui-yan Li, Theoretical study on the gas adsorption capacity and selectivity of CPM-200-In/Mg and CPM-200-In/Mg-X(-X = -NH2, -OH, -N, -F), Physical Chemistry Chemical Physics, 2017, 19, 29963-29974.

[19]Yong-Hui Li, Xiao-Le Liu, Zhen-Tao Yu,* Zhao-Sheng Li, Shi-Cheng Yan, Guang-Hui Chen and Zhi-Gang Zou, Osmium(II) Complexes for Light-Driven Aerobic Oxidation of Amines to Imines, Dalton Transactions, 2016, 45, 12400-12408.

[20]Zhen-Tao Yu,* Xiao-Le Liu, Yong-Jun Yuan, Yong-Hui Li, Guang-Hui Chen and Zhi-Gang Zou, Evaluation of Bis-Cyclometalated Alkynylgold(III) Sensitizers for Water Photoreduction to Hydrogen, Dalton Transactions, 2016, 45, 17223-17232.

[21]Wei Chen, Guang-Hui Chen,* Di Wu and Qiang Wang, BNg3 F3: the first three noble gas atoms inserted into mono-centric neutral compounds–a theoretical study, Physical Chemistry Chemical Physics, 2016, 18, 17534-17545.